⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL18963343 | 1.00 | — | — | |
| SCHEMBL12417418 | 0.90 | LMNA (0.34) | — | |
| SCHEMBL12417421 | 0.90 | LMNA (0.34) | — | |
| SCHEMBL12417416 | 0.90 | LMNA (0.34) | — | |
| SCHEMBL18963318 | 0.88 | LMNA (0.35) | — | |
| SCHEMBL18963320 | 0.83 | ADRB2 (0.31) | — | |
| SCHEMBL12417417 | 0.79 | HPGD (0.33) | — | |
| SCHEMBL18963268 | 0.72 | PKM (0.34) | — | |
| SCHEMBL18963373 | 0.72 | CES2 (0.39) | — | |
| SCHEMBL18963372 | 0.72 | PKM (0.34) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421878-B1 | ANIONIC OLIGOSACCHARIDE CONJUGATES | GLYCAN BIOSCIENCES LLC (US) | 2017-06-14 | — | — | EP | disclosed |